4-(2,3,4,6-tetra-O-acetyl-beta-D-galactopyranosyloxy)-3-(2-phenylethyl)benzofuran

HCID 67136015
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Basic information

Standard SMILES
CC(=O)OC[C@H]1O[C@@H](Oc2cccc3occ(CCc4ccccc4)c23)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O
InChIKey
OTEQYCKWMASZJB-AARHSHDHSA-N
Molecular formula
C30H32O11
Average molar mass
568.6 g/mol
Monoisotopic mass
568.19446183

Names & identifiers

Preferred name
4-(2,3,4,6-tetra-O-acetyl-beta-D-galactopyranosyloxy)-3-(2-phenylethyl)benzofuran
IUPAC
[(2R,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[[3-(2-phenylethyl)-1-benzofuran-4-yl]oxy]oxan-2-yl]methyl acetate

Names & synonyms

SCHEMBL1727360OTEQYCKWMASZJB-AARHSHDHSA-N4-(2,3,4,6-tetra-O-acetyl-beta-D-galactopyranosyloxy)-3-(2-phenylethyl)benzofuran

Database identifiers

PubChem CID
67136015

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
137 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
11
Rotatable bonds
14
Heavy atoms
41

Related reactions

1 records
New reaction record

Compound notes

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